1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide

C8H10N4 — CID 155660949

IUPAC1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide
SMILES[H]/N=C(\N)c1ccc2n1C=CNC2
InChIInChI=1S/C8H10N4/c9-8(10)7-2-1-6-5-11-3-4-12(6)7/h1-4,11H,5H2,(H3,9,10)
InChIKeyLXMJZQBDAWKLES-UHFFFAOYSA-N
MW162.20 g/mol
LogP0.30
Rot. Bonds1

About 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide

1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide (PubChem CID 155660949) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide.

Molecular Properties

Compound Name1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide
PubChem CID155660949
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide
SMILES[H]/N=C(\N)c1ccc2n1C=CNC2
InChIInChI=1S/C8H10N4/c9-8(10)7-2-1-6-5-11-3-4-12(6)7/h1-4,11H,5H2,(H3,9,10)
InChIKeyLXMJZQBDAWKLES-UHFFFAOYSA-N
XLogP0.30
TPSA66.83 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

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CID 170597255
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2-methylpyrrolo[2,1-f][1,2,4]triazine-7-carboximidamide
CID 83874408
3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-5-carboximidamide
CID 83881581
4-fluorobenzenecarboximidamide;hydroiodide
CID 68780775
3-(2-fluorophenyl)imidazole-4-carboximidamide
CID 83881803
tetrazolo[1,5-a]pyridine-5-carboximidamide
CID 83873084
5-chloro-2-(2,6-dimethylmorpholin-4-yl)benzenecarboximidamide
CID 62493250
3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide
CID 83880717
3-methyltriazole-4-carboximidamide;hydrochloride
CID 175806610
3-tert-butylimidazole-4-carboximidamide
CID 83873560
1,2,3,4-tetrahydroisoquinoline-6-carboximidamide
CID 54411310

Frequently Asked Questions

What is the IUPAC name of 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide?
The IUPAC name of 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide (CID 155660949) is 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide.
What is the SMILES notation for 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide?
The canonical SMILES for 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide is [H]/N=C(\N)c1ccc2n1C=CNC2.
What is the InChIKey of 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide?
The InChIKey is LXMJZQBDAWKLES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c9-8(10)7-2-1-6-5-11-3-4-12(6)7/h1-4,11H,5H2,(H3,9,10).
What are the key properties of 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide?
1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide has a molecular weight of 162.20 g/mol, XLogP of 0.30, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydropyrrolo[1,2-a]pyrazine-6-carboximidamide is sourced from PubChem (CID 155660949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).